L068-0156 Screening compound: ethyl 7-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethoxy]-6-methyl-2-propanamido-1-benzothiophene-3-carboxylate

L068-0156 Screening compound: ethyl 7-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethoxy]-6-methyl-2-propanamido-1-benzothiophene-3-carboxylate
L068-0156 Screening compound: ethyl 7-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethoxy]-6-methyl-2-propanamido-1-benzothiophene-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound L068-0156
ethyl 7-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethoxy]-6-methyl-2-propanamido-1-benzothiophene-3-carboxylate

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

L068-0156

Molecular Formula

C25H26N2O5S (C25 H26 N2 O5 S)

Compound Name

ethyl 7-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethoxy]-6-methyl-2-propanamido-1-benzothiophene-3-carboxylate

IUPAC name

ethyl 7-[2-(23-dihydro-1H-indol-1-yl)-2-oxoethoxy]-6-methyl-2-propanamido-1-benzothiophene-3-carboxylate

SMILES

CCC(Nc1c(C(OCC)=O)c2ccc(C)c(OCC(N(CC3)c4c3cccc4)=O)c2s1)=O

InChI

InChI=1S/C25H26N2O5S/c1-4-19(28)26-24-21(25(30)31-5-2)17-11-10-15(3)22(23(17)33-24)32-14-20(29)27-13-12-16-8-6-7-9-18(16)27/h6-11H,4-5,12-14H2,1-3H3,(H,26,28)

InChI Key

IUYHPTMUTUNBDK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15117430

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

466.56

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.611

Distribution Coefficient, logD

4.599

Water Solubility, LogSw

-4.52

Polar Surface Area

66.488

Acid Dissociation Constant (pKa)

8.93

Base Dissociation Constant (pKb)

-0.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.00

L068-0156 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with L068-0156 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L068-0156?
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What is the minimum amount of L068-0156 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L068-0156
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L068-0156
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of L068-0156 available by request